mp_ID
stringlengths
4
10
x
float64
-10.28
17.7
y
float64
-12.01
23.9
z
float64
-8.99
7.96
type
stringclasses
2 values
formula
stringlengths
2
26
n_atoms
int64
1
444
spacegroup
int64
1
230
volume
float64
5.61
20.1k
mp-1203960
10.103308
3.286767
-3.825355
other
U4H24Br8O20
56
14
858.85
mp-1105180
-4.167091
-3.386239
-3.575157
other
Sr4Sb4Se6O4
18
14
444.16
mp-1047948
9.032645
0.623548
0.898381
other
Ba4Ca4Mn4F28
40
14
613.69
mp-772564
9.094906
4.070762
-5.206474
other
Ni2H16C4O20
42
14
410.15
mp-720644
10.096672
2.347131
-4.334411
other
P4H36N8O16
64
14
553.19
mp-26875
14.384271
7.190549
-5.850356
other
Li8Cu4P4O16
32
14
345.86
mp-1282800
11.572613
10.999683
0.42394
other
Ca4Cr2W2O12
20
14
238.82
mp-555876
12.781323
8.522883
-6.127261
other
Ba2Mo4P8O32
46
14
608.57
mp-1198842
-2.931335
-0.740466
-5.327139
other
Cs8Cu8P8S24
48
14
1,321.57
mp-558169
8.971529
0.953943
1.431485
other
Na8Ca8Al8F48
72
14
899.78
mp-1208507
11.588448
8.921511
-5.446311
other
Tl8Mo12P12O68
100
14
1,570.97
mp-26313
12.321312
7.457248
-7.299767
other
Li8Ni10P12O44
74
14
838.12
mp-557217
14.523418
7.897236
-4.958253
other
Cr8P4I4O16
32
14
519.87
mp-8496
10.060539
9.644814
3.567671
other
Sr4Sm2Nb2O12
20
14
299.26
mp-14382
10.508869
12.253468
-3.670761
other
Ca8V16Co8O56
88
14
1,127.71
mp-1209323
8.678013
5.856996
-6.166202
other
Sm4Tl4S8O36
52
14
829.98
mp-1041319
9.029944
1.729991
1.466522
other
Ba4Ti4Zn4F28
40
14
557.28
mp-1195020
-4.09188
-2.476482
-3.287129
other
Pr4Tl4P8Se24
40
14
1,115.08
mp-687204
10.893467
10.971842
-3.816695
other
Nd4Re4Mo4O32
44
14
776.22
mp-777730
13.790141
4.276246
-2.294658
other
Li12Bi4B32O60
108
14
1,350.78
mp-1202539
7.190583
0.34781
-3.707557
other
B80H168N16O12
276
14
2,464.43
mp-757597
13.379652
6.837449
-6.665061
other
Li4Sn4P16O48
72
14
974.88
mp-1210974
7.752274
1.912806
-4.646498
other
Li4H8C4N20
36
14
361.21
mp-1180732
8.410723
4.733236
-4.914117
other
Na12As4S16O32
64
14
1,256.59
mp-721876
12.013626
5.033957
-5.325296
other
Al4P8H20O36
68
14
652.14
mp-1198983
6.515867
5.714501
-4.233331
other
Hg16P4N4O32
56
14
990.79
mp-557367
11.561244
7.163576
-3.851937
other
K8Ca4As8O28
48
14
797.42
mp-653561
-3.528176
-1.664589
-5.552335
other
Tl8Ge4Pb4S16
32
14
889.84
mp-31969
11.306581
7.985073
-7.890885
other
Li12Mn8P12O48
80
14
904.4
mp-1210970
11.467366
4.337916
-5.146155
other
Mn4P8H24O20
56
14
640.48
mp-569970
-0.705179
1.11529
-4.200122
other
Zr2Hg6Se4Br12
24
14
777.86
mp-32022
11.541707
7.907896
-8.027695
other
Li4Mn4P8O28
44
14
548.11
mp-652854
5.485726
3.150839
-4.600162
other
Bi4Ru8C24O24
60
14
1,159.24
mp-773604
11.697456
5.869219
-3.55379
other
Na12Co4B8O24
48
14
552.3
mp-734019
11.060861
4.278409
-3.943943
other
Na8Zn4H16O16
44
14
466.05
mp-727932
9.648994
7.612516
-2.091466
other
Be4Al4Si4O20
32
14
320.65
mp-758455
13.612193
8.612138
-5.585908
other
Li4P12W8O52
76
14
1,154.35
mp-26307
11.120477
7.834163
-7.600417
other
Li6Fe6P8O32
52
14
598.31
mp-1188807
9.658835
10.806479
1.220127
other
Sr4Ca2Re2O12
20
14
284.58
mp-757259
14.425098
7.252146
-7.028691
other
Li12Mn12P12O48
84
14
1,084.27
mp-24536
11.527937
4.776097
-4.977472
other
Co2P4H16O20
42
14
388.14
mp-1198502
8.345204
2.262831
-1.061302
other
Sb4P4H8F40
56
14
812.89
mp-673059
13.500425
7.223537
-6.38684
other
Li4Sb4P8O28
44
14
543.45
mp-780394
14.249359
7.699486
-6.726534
other
Li4Mn12P12O44
72
14
853.71
mp-1188474
8.41615
13.762981
-1.023666
other
Mn2In4Ni2O12
20
14
217.39
mp-26201
9.914897
8.274266
-6.609835
other
Li6Co6P8O32
52
14
566.12
mp-6758
-5.19807
-6.120152
0.656302
other
K4Na16Sn4Sb12
36
14
1,153.75
mp-1044590
14.122323
7.491462
-6.918521
other
Ca2Mn6P8O28
44
14
546.26
mp-557473
11.071703
7.757114
-0.348495
other
K20Li4Ge8O28
60
14
1,030.7
mp-26749
11.552228
7.690878
-7.593738
other
Li4Fe4P8O28
44
14
502.96
mp-834376
9.285862
8.419349
-5.337505
other
V8P8N4O44
64
14
928.35
mp-541436
13.901433
6.365699
-6.471483
other
Nb4Tl4P8O32
48
14
764.62
mp-555929
9.807416
11.420454
0.784338
other
Sr4Mn2Mo2O12
20
14
267.57
mp-1209824
9.055762
3.37439
-5.704885
other
Pr4H24C12O36
76
14
851.62
mp-556375
9.118355
9.113951
2.301314
other
Ba4La2Sb2O12
20
14
333.88
mp-1198224
10.977433
4.065151
-6.567951
other
Er8H8S8O40
64
14
711.13
mp-782667
13.478812
7.649014
-0.763762
other
Li8Mn4Si4O16
32
14
358.98
mp-1200133
8.089969
5.39751
-6.118418
other
Mg4Cu4C4O20
32
14
369.69
mp-1198918
12.355326
6.919065
-6.872945
other
Rb4Cu6P8O28
46
14
647.53
mp-558466
7.895965
2.328172
-1.32965
other
As4S4Br12F24
44
14
977.3
mp-505469
10.07018
5.761319
-4.011156
other
Co4H8Se4O16
32
14
377.35
mp-561065
13.987373
6.223251
-6.879315
other
Mg2Ti4P4O20
30
14
359.18
mp-1195841
9.462305
7.058085
-3.4825
other
V4Pb8Se12O40
64
14
992.74
mp-1212515
8.100294
2.597135
-4.811562
other
H8C12N8O12
40
14
490.08
mp-24547
9.029671
6.467811
-4.092723
other
Zn2H4Se4O16
26
14
338.12
mp-558124
9.357927
5.174204
-6.476194
other
K8Mo4S8O40
60
14
984.84
mp-1203682
7.573919
9.600328
-3.820998
other
Cr8Fe4N4O32
48
14
744.21
mp-18343
13.316544
5.484799
-6.489097
other
Ba4Mg4P8O28
44
14
621.92
mp-1209196
13.611545
5.273337
-6.664011
other
Rb4Tm4P8O28
44
14
722.32
mp-1211103
6.73503
6.387277
-3.791769
other
Pr4I4Cl4O52
64
14
1,149.16
mp-559395
13.777827
5.222521
-6.767381
other
K4Lu4P8O28
44
14
682.54
mp-1203215
5.468976
-0.378615
-3.05062
other
K8Mn4B16H64
92
14
1,075.83
mp-1192442
11.869344
11.284294
-3.173138
other
Ce4Mo4O16F4
28
14
426.58
mp-735521
10.286357
2.607179
-3.145899
other
Mn4H24O12F12
52
14
490.7
mp-562513
10.727562
10.804734
-3.376656
other
Cs4U4V4O24
36
14
680.19
mp-726684
10.123755
7.201645
-5.588312
other
Ba6U4P8O40
58
14
912.82
mp-759758
8.23555
3.979165
-7.088429
other
Li8Ni4C8O24
44
14
551.98
mp-1214856
3.026979
2.80838
-4.281189
other
Al4S4N4Cl12
24
14
642.73
mp-1211868
9.675159
8.966507
2.418084
other
La4Mg2Sn2O12
20
14
267.61
mp-774352
10.074504
8.199263
-6.630269
other
Li12Co8P12O48
80
14
916.32
mp-556050
6.863291
3.158635
-2.894768
other
P32S8N48F48
136
14
2,301.95
mp-560518
8.932088
0.808784
1.428218
other
Rb4Li8Be8F28
48
14
644.77
mp-662789
8.06685
2.141691
-1.16795
other
Te12As8S12F48
80
14
1,599.96
mp-558445
11.961571
8.522862
-3.021497
other
La8B8Mo8O48
72
14
951.69
mp-540981
10.320775
4.370723
-6.31094
other
Cs4H4S4O16
28
14
452.35
mp-6331
13.445429
4.696939
-1.453496
other
Na8Y8B8O28
52
14
616.31
mp-557413
10.667955
9.339964
-4.012425
other
Rb8Mo12S4O52
76
14
1,238.52
mp-12451
8.424933
10.395881
1.836528
other
Li2La4Os2O12
20
14
249.18
mp-557086
11.570459
11.318712
-3.996344
other
Tm4Mo4O16F4
28
14
392.31
mp-1200309
7.566947
4.930884
-5.441564
other
Hf4Cd4C24O68
100
14
1,453.29
mp-1047947
9.203331
0.588381
0.424746
other
Ba4Ca4Co4F28
40
14
603.19
mp-1200860
14.173668
5.155317
-7.156136
other
Na4Sc4P8O28
44
14
587.36
mp-1202018
9.099152
1.723461
-4.037306
other
Cs8H32N8O8
56
14
718.04
mp-556250
13.810284
4.123901
-2.196173
other
K4Sr4B20O36
64
14
782.92
mp-732203
8.363578
2.343323
-0.875396
other
Si2Hg4O4F12
22
14
365.95
mp-1208082
11.712642
7.76747
-4.287667
other
V4As8Pb8O36
56
14
784.47
mp-27069
12.799525
6.471735
-6.256541
other
Li12Bi8P12O48
80
14
1,080.63
mp-683995
5.910549
3.397586
-4.606763
other
Re12C56N4O64
136
14
2,346.18
mp-1211522
11.033379
10.25956
2.3962
other
La4Nb2Ni2O12
20
14
260.67
mp-643743
9.979877
3.938121
-4.031655
other
Cu4H4Cl4O4
16
14
212